Structure of PDB 6hs4 Chain A

Receptor sequence

>6hs4A (length=258) Species: 128952 (Ebola virus - Mayinga, Zaire, 1976) [Search protein sequence]

GRSIPLGVIHNSALQVSDVDKLVCRDKLSSTNQLRSVGLNLEGNGVATDV
PSATKRWGFRSGVPPKVVNYEAGEWAENCYNLEIKKPDGSECLPAAPDGI
RGFPRCRYVHKVSGTGPCAGDFAFHKEGAFFLYDRLASTVIYRGTTFAEG
VVAFLILPQASGYYSTTIRYQATGFGTNETEYLFEVDNLTYVQLESRFTP
QFLLQLNETIYTSGKRSNTTGKLIWKVNPEIDTTEWAFWETSEELSFTVV
AAAAAAAA

3D structure

PDB

6hs4 Structure-Based in Silico Screening Identifies a Potent Ebolavirus Inhibitor from a Traditional Chinese Medicine Library.

Chain

Resolution

2.05 Å

3D
structure

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Enzymatic activity

Enzyme Commision number

Interaction with ligand

Site #	Ligand	Ligand chain	Binding residues on receptor (original residue number in PDB)	Binding residues on receptor (residue number reindexed from 1)	Binding affinity
BS01	GON	A	L186 P187 A189	L157 P158 A160	MOAD: ic50=3.1uM PDBbind-CN: -logKd/Ki=5.51,IC50=3.1uM
BS02	GON	A	R64 V66 E100	R35 V37 E71	MOAD: ic50=3.1uM PDBbind-CN: -logKd/Ki=5.51,IC50=3.1uM

External links

PDB	RCSB:6hs4, PDBe:6hs4, PDBj:6hs4
PDBsum	6hs4
PubMed	30785281
UniProt	Q05320\|VGP_EBOZM Envelope glycoprotein (Gene Name=GP)

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